Test set for materials science and engineering with user-friendly graphic tools for error analysis: Systematic benchmark of the numerical and intrinsic errors in state-of-the-art electronic-structure approximations

This item is discarded!DetailsSummary

Zhang, I. Y., Logsdail, A. J., Ren, X., Levchenko, S. V., Ghiringhelli, L. M., & Scheffler, M. (in preparation). Test set for materials science and engineering with user-friendly graphic tools for error analysis: Systematic benchmark of the numerical and intrinsic errors in state-of-the-art electronic-structure approximations.

Item is Discarded

Basic (Discarded)

Date of Discard: 2019-06-19

Comment: ist jetzt item_3013645

Creators:
Zhang, Igor Ying^{1, 2, 3}
Logsdail, Andrew J.⁴
Ren, Xinguo⁵
Levchenko, Sergey V.¹
Ghiringhelli, Luca M.¹
Scheffler, Matthias¹

Affiliations:
1Theory, Fritz Haber Institute, Max Planck Society, ou_634547
2Department of Chemistry, Fudan University, Shanghai 200433, China, ou_persistent22
3MOE Key Laboratory of Computational Physical Science, Fudan University, Shanghai 200433, China, ou_persistent22
4Cardiff Catalysis Institute, School of Chemistry, Cardiff University, Cardiff, UK, ou_persistent22
5Key Laboratory of Quantum Information, University of Science and Technology of China, Hefei 230026, China, ou_persistent22

Dates: Created: 2018-08-29

Files: 1 File

Locators: 0 Locators

version ID: item_2639855_1

Item State: Discarded

Name of Context: Publications of the Fritz Haber Institute, Affiliated to: Fritz Haber Institute